N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide

C18H19FN2O2 — CID 58368163

IUPACN-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide
SMILESCc1nc(OCc2cccc(F)c2)ccc1C(=O)NCC1CC1
InChIInChI=1S/C18H19FN2O2/c1-12-16(18(22)20-10-13-5-6-13)7-8-17(21-12)23-11-14-3-2-4-15(19)9-14/h2-4,7-9,13H,5-6,10-11H2,1H3,(H,20,22)
InChIKeyKQGQPWCPINQTNT-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.25
Rot. Bonds6

About N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide

N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide (PubChem CID 58368163) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide
PubChem CID58368163
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide
SMILESCc1nc(OCc2cccc(F)c2)ccc1C(=O)NCC1CC1
InChIInChI=1S/C18H19FN2O2/c1-12-16(18(22)20-10-13-5-6-13)7-8-17(21-12)23-11-14-3-2-4-15(19)9-14/h2-4,7-9,13H,5-6,10-11H2,1H3,(H,20,22)
InChIKeyKQGQPWCPINQTNT-UHFFFAOYSA-N
XLogP3.25
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide (CID 58368163) is N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide is Cc1nc(OCc2cccc(F)c2)ccc1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide?
The InChIKey is KQGQPWCPINQTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-12-16(18(22)20-10-13-5-6-13)7-8-17(21-12)23-11-14-3-2-4-15(19)9-14/h2-4,7-9,13H,5-6,10-11H2,1H3,(H,20,22).
What are the key properties of N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide?
N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide has a molecular weight of 314.36 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-[(3-fluorophenyl)methoxy]-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 58368163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).